SCHEMBL2410185

SCHEMBL2410185

[c]1ccc2cccc3c4[c]ccc5cccc(c1c23)c54

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 10/20 0.42
HSD17B10 Q99714 8/20 0.42
HPGD P15428 6/20 0.42
CYP1A2 P05177 5/20 0.42
THRB P10828 1/20 0.42
TSHR P16473 8/20 0.39
CYP3A4 P08684 4/20 0.39
CYP1A1 P04798 1/20 0.39
CYP1B1 Q16678 1/20 0.39
ERBB2 P04626 1/20 0.34
FYN P06241 1/20 0.34
MAOA P21397 1/20 0.34
ACHE P22303 1/20 0.34
AHR P35869 1/20 0.34
L3MBTL1 Q9Y468 3/20 0.33
MAPK1 P28482 3/20 0.33
ATM Q13315 1/20 0.33
TDP1 Q9NUW8 2/20 0.32
CYP2A6 P11509 3/20 0.32
KEAP1 Q14145 1/20 0.31

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL1047443 0.96 ALDH1A1 (0.44) ALDH1A1HSD17B10HPGDCYP1A2THRB
SCHEMBL2410430 0.93 ALDH1A1 (0.41) ALDH1A1HSD17B10HPGDCYP1A2THRB
SCHEMBL2405885 0.91 ALDH1A1 (0.48) ALDH1A1HSD17B10HPGDCYP1A2THRB
SCHEMBL456343 0.89 ALDH1A1 (0.48) ALDH1A1HSD17B10HPGDCYP1A2THRB
SCHEMBL2413155 0.87 CYP1A2 (0.38) ALDH1A1HSD17B10HPGDCYP1A2THRB
SCHEMBL2408476 0.87 CYP1A2 (0.38) ALDH1A1HSD17B10HPGDCYP1A2THRB
SCHEMBL17350306 0.86 CYP1A2 (0.40) ALDH1A1HSD17B10HPGDCYP1A2THRB
SCHEMBL15936077 0.84 CYP1A2 (0.39) ALDH1A1HSD17B10HPGDCYP1A2THRB
SCHEMBL2408908 0.84 CYP1A2 (0.35) ALDH1A1HSD17B10HPGDCYP1A2THRB
SCHEMBL2408262 0.84 CYP1A2 (0.35) ALDH1A1HSD17B10HPGDCYP1A2THRB

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8357821-B2 Aromatic amine compound, organic electroluminescent element including the same, and display device including organic electroluminescent element SONY CORPORATION (JP) 2013-01-22 US disclosed
WO-2011105700-A1 NOVEL ORGANIC ELECTROLUMINESCENT COMPOUNDS AND ORGANIC ELECTROLUMINESCENT DEVICE USING THE SAME ROHM AND HAAS ELECTRONIC MATERIALS KOREA LTD. (KR) 2011-09-01 WO disclosed
US-20100109555-A1 AROMATIC AMINE COMPOUND, ORGANIC ELECTROLUMINESCENT ELEMENT INCLUDING THE SAME, AND DISPLAY DEVICE INCLUDING ORGANIC ELECTROLUMINESCENT ELEMENT SONY CORPORATION (JP) 2010-05-06 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20100109555-A1 AROMATIC AMINE COMPOUND, ORGANIC ELECTROLUMINESCENT ELEMENT INCLUDING THE SAME, AND DISPLAY DEVICE INCLUDING ORGANIC ELECTROLUMINESCENT ELEMENT AOC2, NR2E1, AOC3 ALDH1A1 221/4885HSD17B10 1737/4885HPGD 3193/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.